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1588441-06-8 | Piperazine, 1-(diphenylmethyl)-, hydrate (1:1)
CAS No: 1588441-06-8 Catalog No: AG001QXZ MDL No:MFCD24847836
Product Description
Catalog Number:
AG001QXZ
Chemical Name:
Piperazine, 1-(diphenylmethyl)-, hydrate (1:1)
CAS Number:
1588441-06-8
Molecular Formula:
C17H22N2O
Molecular Weight:
270.3694
MDL Number:
MFCD24847836
IUPAC Name:
1-benzhydrylpiperazine;hydrate
InChI:
InChI=1S/C17H20N2.H2O/c1-3-7-15(8-4-1)17(16-9-5-2-6-10-16)19-13-11-18-12-14-19;/h1-10,17-18H,11-14H2;1H2
InChI Key:
VHSDFUFIRZBPMS-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)C(c1ccccc1)c1ccccc1.O
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.173g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
270.376g/mol
Monoisotopic Mass:
270.173g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
16.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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